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	hartrees
Energy at 0K	-46.348396
Energy at 298.15K	-46.349631
Nuclear repulsion energy	35.750821

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3153	3054	30.12
2	A'	1745	1689	237.93
3	A'	1337	1295	1.02
4	A'	973	942	235.53
5	A'	598	579	21.65
6	A"	972	941	2.87

Atom	x (Å)	y (Å)
C1	0.000	0.426
O2	1.187	0.154
F3	-1.001	-0.578
H4	-0.488	1.412

	C1	O2	F3	H4
C1		1.2180	1.4175	1.1010
O2	1.2180		2.3078	2.0953
F3	1.4175	2.3078		2.0554
H4	1.1010	2.0953	2.0554

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	F3	122.069		O2	C1	H4	129.186
F3	C1	H4	108.745

All results from a given calculation for HFCO (formyl fluoride)

using model chemistry: B3LYP/CEP-31G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	C	-0.030
2	O	-0.029
3	F	-0.165
4	H	0.224

	x	y	z	Total
	-1.231	2.306	0.000	2.614
CHELPG
AIM
ESP

	x	y	z
x	2.897	0.106	0.000
y	0.106	1.793	0.000
z	0.000	0.000	1.135

<r²>	0.000
(<r²>)^1/2	0.000